2-(2-bromanyl-5-methoxy-phenyl)sulfanyl-1-pent-4-ynyl-imidazo[4,5-c]pyridin-4-amine

Systemtic Name: 2-(2-bromanyl-5-methoxy-phenyl)sulfanyl-1-pent-4-ynyl-imidazo[4,5-c]pyridin-4-amine Openeye Name: 2-(2-bromo-5-methoxy-phenyl)sulfanyl-1-pent-4-ynyl-imidazo[4,5-c]pyridin-4-amine CAS Name: 2-[(2-bromo-5-methoxyphenyl)thio]-1-pent-4-ynyl-4-imidazo[4,5-c]pyridinamine IUPAC Name: 2-(2-bromo-5-methoxyphenyl)sulfanyl-1-pent-4-ynylimidazo[4,5-c]pyridin-4-amine Traditional Name: [2-[(2-bromo-5-methoxy-phenyl)thio]-1-pent-4-ynyl-imidazo[4,5-c]pyridin-4-yl]amine Formula: C18H17BrN4OS MolecularWeight: 417.32278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)SC2=NC3=C(N2CCCC#C)C=CN=C3N

Isomeric SMILES

COC1=CC(=C(C=C1)Br)SC2=NC3=C(N2CCCC#C)C=CN=C3N

InChI

InChI=1S/C18H17BrN4OS/c1-3-4-5-10-23-14-8-9-21-17(20)16(14)22-18(23)25-15-11-12(24-2)6-7-13(15)19/h1,6-9,11H,4-5,10H2,2H3,(H2,20,21)